5 109 (N_temp, Lch) 105 222.450 1 3nwrA1 ATOM 1001 CA GLY 1 15.598 -1.085 24.648 3 THR ATOM 1002 CA ILE 2 17.112 -2.746 21.635 4 LEU ATOM 1003 CA ILE 3 20.816 -3.107 20.916 5 GLU ATOM 1004 CA ALA 4 22.813 -2.595 17.738 6 ALA ATOM 1005 CA THR 5 26.447 -3.598 17.162 7 ASP ATOM 1006 CA TYR 6 28.701 -1.721 14.715 8 TYR ATOM 1007 CA LEU 7 32.198 -1.806 13.335 9 LEU ATOM 1008 CA ILE 8 33.437 1.764 13.021 10 ILE ATOM 1009 CA HIS 9 36.607 3.298 11.621 11 GLU ATOM 1010 CA ASP 10 37.840 6.800 12.416 12 THR ATOM 1011 CA ASP 11 41.109 8.690 12.858 13 PRO ATOM 1012 CA HIS 13 39.416 10.350 15.841 14 LEU ATOM 1013 CA ASN 14 38.672 8.877 19.278 15 ASP ATOM 1014 CA LEU 15 36.419 5.818 18.792 16 PRO ATOM 1015 CA GLU 16 34.544 6.340 22.070 17 ALA ATOM 1016 CA LYS 17 33.742 9.972 21.246 18 ARG ATOM 1017 CA LYS 18 32.615 8.986 17.761 19 VAL ATOM 1018 CA ALA 19 30.431 6.212 19.177 20 ALA ATOM 1019 CA GLU 20 28.649 8.757 21.342 21 ASP ATOM 1020 CA GLN 21 28.259 11.112 18.381 22 VAL ATOM 1021 CA ILE 22 26.514 8.173 16.683 23 MET ATOM 1022 CA ALA 23 24.328 7.524 19.724 24 ALA ATOM 1023 CA LEU 24 23.363 11.183 20.003 25 GLY ATOM 1024 CA GLY 25 22.723 11.784 16.323 26 GLU ATOM 1025 CA LEU 26 20.441 8.746 16.060 27 GLN ATOM 1026 CA THR 27 18.439 9.809 19.102 28 SER ATOM 1027 CA ILE 28 18.064 13.031 21.122 29 SER ATOM 1028 CA GLY 29 21.606 14.440 20.902 30 GLY ATOM 1029 CA LYS 33 16.571 9.895 30.190 31 ALA ATOM 1030 CA GLN 34 13.688 8.602 28.074 32 ARG ATOM 1031 CA HIS 35 15.189 9.303 24.660 33 SER ATOM 1032 CA LYS 36 18.991 9.369 24.601 34 ARG ATOM 1033 CA GLY 37 20.696 6.276 23.164 35 ALA ATOM 1034 CA ASN 38 23.811 5.058 24.992 36 SER ATOM 1035 CA VAL 39 27.115 3.371 24.189 37 VAL ATOM 1036 CA ILE 40 27.194 0.054 26.062 38 LEU ATOM 1037 CA HIS 41 30.425 -1.407 24.689 39 ARG ATOM 1038 CA VAL 42 33.560 -0.278 22.916 40 ILE ATOM 1039 CA GLU 43 36.424 -2.551 21.907 41 GLU ATOM 1040 CA GLU 44 39.329 -1.120 19.948 42 GLU ATOM 1041 CA LEU 45 40.698 -3.357 17.192 43 LEU ATOM 1042 CA ALA 46 43.820 -3.190 15.040 44 GLU ATOM 1043 CA GLU 47 43.982 0.161 13.240 45 ALA ATOM 1044 CA HIS 48 43.989 0.502 9.464 46 ALA ATOM 1045 CA GLU 49 47.015 2.016 7.708 47 ALA ATOM 1046 CA HIS 50 44.762 3.683 5.134 48 ARG ATOM 1047 CA THR 51 41.162 4.964 5.360 49 PRO ATOM 1048 CA ASN 52 38.540 2.542 4.018 50 SER ATOM 1049 CA SER 53 36.307 5.330 2.668 51 LEU ATOM 1050 CA TYR 54 36.869 8.844 1.309 52 PRO ATOM 1051 CA LEU 55 35.755 11.629 3.613 53 ASN ATOM 1052 CA ARG 56 46.280 12.387 10.401 62 PRO ATOM 1053 CA LYS 57 46.041 8.609 10.572 63 GLY ATOM 1054 CA LYS 58 46.118 5.927 11.663 64 PRO ATOM 1055 CA VAL 59 42.487 4.990 11.058 65 TRP ATOM 1056 CA LYS 60 41.375 3.397 14.278 66 ARG ATOM 1057 CA ARG 61 38.821 0.596 14.311 67 ARG ATOM 1058 CA GLY 62 36.384 -0.463 16.999 68 ALA ATOM 1059 CA ILE 63 33.413 -2.726 17.605 69 ARG ATOM 1060 CA ILE 64 30.712 -0.848 19.483 70 ILE ATOM 1061 CA LYS 65 27.280 -1.572 20.906 71 THR ATOM 1062 CA ILE 66 24.552 1.062 21.087 72 LEU ATOM 1063 CA GLU 67 21.422 0.826 23.231 73 SER ATOM 1064 CA TYR 68 18.291 2.513 21.839 74 PHE ATOM 1065 CA PRO 69 15.115 3.304 23.802 75 PRO ATOM 1066 CA LEU 70 12.155 1.600 22.113 76 LEU ATOM 1067 CA LEU 71 9.894 4.515 23.003 77 ALA ATOM 1068 CA ASN 72 11.792 6.580 20.399 78 ASN ATOM 1069 CA PHE 73 10.662 4.231 17.628 79 ILE ATOM 1070 CA SER 74 7.627 2.205 18.614 80 ASP ATOM 1071 CA PRO 75 6.674 -0.594 16.181 81 ALA ATOM 1072 CA ASP 76 7.674 1.321 13.070 82 ASN ATOM 1073 CA LEU 77 9.838 -0.858 10.818 83 LEU ATOM 1074 CA PRO 78 11.159 1.698 8.325 84 PRO ATOM 1075 CA ALA 79 11.900 4.209 11.105 85 THR ATOM 1076 CA ILE 80 13.683 1.445 13.013 86 LEU ATOM 1077 CA LEU 81 15.923 1.183 9.940 87 ALA ATOM 1078 CA THR 82 16.329 4.987 9.805 88 ALA ATOM 1079 CA THR 83 17.448 4.832 13.432 89 THR ATOM 1080 CA THR 84 19.940 1.943 13.484 90 VAL ATOM 1081 CA PHE 85 21.293 2.537 10.007 91 ALA ATOM 1082 CA GLY 86 20.184 5.836 8.450 92 GLY ATOM 1083 CA LYS 87 22.511 8.851 8.432 93 ASN ATOM 1084 CA LEU 88 25.204 7.020 10.458 94 LEU ATOM 1085 CA SER 89 26.897 6.072 7.207 95 TYR ATOM 1086 CA LEU 90 27.422 9.735 6.315 96 ASP ATOM 1087 CA ASP 91 34.010 8.147 10.146 100 VAL ATOM 1088 CA GLY 92 35.943 6.430 7.372 101 THR ATOM 1089 CA GLU 93 34.007 3.208 7.961 102 GLY ATOM 1090 CA VAL 94 30.675 2.220 9.530 103 VAL ATOM 1091 CA LYS 95 28.895 -1.112 9.305 104 ARG ATOM 1092 CA LEU 96 25.867 -2.331 11.215 105 LEU ATOM 1093 CA ILE 97 26.754 -5.876 12.293 106 LEU ATOM 1094 CA ASP 98 23.839 -7.137 14.347 107 SER ATOM 1095 CA LEU 99 20.638 -6.306 16.231 108 LEU ATOM 1096 CA THR 100 19.066 -7.646 19.402 109 ARG ATOM 1097 CA PHE 101 15.369 -7.045 20.016 110 LEU ATOM 1098 CA SER 102 13.222 -8.076 22.996 111 PRO ATOM 1099 CA ASP 103 10.577 -10.681 22.208 112 ALA ATOM 1100 CA GLU 104 7.798 -8.322 23.314 113 SER ATOM 1101 CA LEU 105 8.983 -5.776 20.748 114 TYR ATOM 1102 CA LYS 106 9.429 -8.350 17.966 115 ARG ATOM 1103 CA LYS 107 5.830 -9.416 18.588 116 ALA ATOM 1104 CA HIS 108 4.613 -5.966 17.516 117 ARG ATOM 1105 CA PHE 109 5.766 -6.598 13.953 118 PHE TER 108 232.900 2 2qygA1 ATOM 2001 CA GLY 1 40.370 -2.741 -18.148 21 TYR ATOM 2002 CA ILE 2 36.726 -3.355 -17.467 22 ILE ATOM 2003 CA ILE 3 34.404 -1.913 -20.078 23 GLU ATOM 2004 CA ALA 4 31.311 0.093 -18.989 24 LEU ATOM 2005 CA THR 5 28.331 1.430 -20.935 25 ASP ATOM 2006 CA TYR 6 26.655 4.538 -19.610 26 PHE ATOM 2007 CA LEU 7 23.665 6.418 -20.984 27 ASP ATOM 2008 CA ILE 8 23.404 9.888 -19.551 28 PHE ATOM 2009 CA HIS 9 22.165 13.440 -19.957 29 GLU ATOM 2010 CA ASP 10 24.432 16.422 -19.395 30 CYS ATOM 2011 CA ASP 11 24.474 20.216 -19.709 31 ALA ATOM 2012 CA HIS 13 27.065 21.998 -21.919 32 GLY ATOM 2013 CA ASN 14 29.850 20.170 -23.763 33 ASP ATOM 2014 CA LEU 15 29.294 16.371 -23.880 34 PRO ATOM 2015 CA GLU 16 33.027 15.967 -24.436 35 HIS ATOM 2016 CA LYS 17 34.038 17.741 -21.223 36 GLU ATOM 2017 CA LYS 18 31.220 15.836 -19.454 37 ALA ATOM 2018 CA ALA 19 32.517 12.402 -20.351 38 ALA ATOM 2019 CA GLU 20 36.056 13.355 -19.321 39 ALA ATOM 2020 CA GLN 21 34.753 14.630 -15.970 40 HIS ATOM 2021 CA ILE 22 32.963 11.369 -15.536 41 LEU ATOM 2022 CA ALA 23 36.120 9.318 -16.007 42 CYS ATOM 2023 CA LEU 24 37.986 11.749 -13.776 43 SER ATOM 2024 CA GLY 25 35.530 11.558 -10.827 44 GLU ATOM 2025 CA LEU 26 35.317 7.812 -11.171 45 GLN ATOM 2026 CA THR 27 39.091 7.369 -10.889 46 SER ATOM 2027 CA ILE 28 41.917 9.912 -10.762 47 THR ATOM 2028 CA GLY 29 40.273 13.367 -10.530 48 ALA ATOM 2029 CA GLU 30 50.352 12.559 -14.784 58 ASP ATOM 2030 CA GLN 31 49.393 9.094 -13.483 59 PHE ATOM 2031 CA LEU 32 46.402 9.087 -15.803 60 ARG ATOM 2032 CA LYS 33 47.828 6.473 -18.246 61 PRO ATOM 2033 CA GLN 34 48.058 3.863 -15.494 62 ARG ATOM 2034 CA HIS 35 45.157 4.796 -13.195 63 PHE ATOM 2035 CA LYS 36 42.506 6.764 -15.058 64 ALA ATOM 2036 CA GLY 37 39.317 5.412 -16.602 65 ALA ATOM 2037 CA ASN 38 39.276 6.398 -20.274 66 LYS ATOM 2038 CA VAL 39 36.641 7.117 -22.898 67 VAL ATOM 2039 CA ILE 40 36.794 4.518 -25.639 68 LEU ATOM 2040 CA HIS 41 33.745 5.679 -27.554 69 GLU ATOM 2041 CA VAL 42 31.192 8.526 -27.284 70 LEU ATOM 2042 CA GLU 43 27.928 9.465 -28.957 71 SER ATOM 2043 CA GLU 44 25.749 12.527 -28.203 72 ALA ATOM 2044 CA LEU 45 22.660 14.061 -29.778 73 GLU ATOM 2045 CA ALA 46 20.979 17.329 -28.717 74 PRO ATOM 2046 CA GLU 47 17.677 17.535 -26.830 75 ARG ATOM 2047 CA HIS 48 16.154 21.030 -26.719 76 PRO ATOM 2048 CA GLU 49 13.451 19.921 -24.333 77 SER ATOM 2049 CA HIS 50 15.931 19.724 -21.420 78 GLY ATOM 2050 CA THR 51 16.229 16.685 -19.113 79 PHE ATOM 2051 CA ASN 52 13.794 13.710 -19.301 80 SER ATOM 2052 CA SER 53 12.428 14.012 -15.774 81 VAL ATOM 2053 CA TYR 54 12.516 17.339 -13.943 82 PRO ATOM 2054 CA LEU 55 15.616 17.542 -11.724 83 VAL ATOM 2055 CA ARG 56 17.960 20.426 -10.705 84 GLU ATOM 2056 CA LYS 57 22.982 25.988 -21.988 89 GLY ATOM 2057 CA LYS 58 22.149 23.016 -24.210 90 PRO ATOM 2058 CA VAL 59 21.270 19.503 -22.873 91 VAL ATOM 2059 CA LYS 60 22.613 16.439 -24.716 92 HIS ATOM 2060 CA ARG 61 21.690 12.740 -24.525 93 ALA ATOM 2061 CA GLY 62 24.774 10.524 -24.525 94 CYS ATOM 2062 CA ILE 63 26.149 6.996 -24.791 95 ARG ATOM 2063 CA ILE 64 29.661 6.218 -23.637 96 VAL ATOM 2064 CA LYS 65 31.911 3.218 -23.332 97 THR ATOM 2065 CA ILE 66 34.506 3.747 -20.596 98 ILE ATOM 2066 CA GLU 67 37.476 1.490 -19.960 99 ALA ATOM 2067 CA TYR 68 38.219 1.429 -16.218 100 HIS ATOM 2068 CA PRO 69 41.619 0.050 -15.049 101 PRO ATOM 2069 CA LEU 70 40.731 -2.746 -12.612 102 HIS ATOM 2070 CA LEU 71 44.172 -2.649 -10.986 103 GLY ATOM 2071 CA ASN 72 42.482 0.242 -9.120 104 ASN ATOM 2072 CA PHE 73 40.409 -2.028 -6.913 105 PHE ATOM 2073 CA SER 74 41.506 -5.629 -7.596 106 GLY ATOM 2074 CA PRO 75 39.066 -8.570 -7.589 107 ALA ATOM 2075 CA ASP 76 36.656 -7.615 -4.769 108 LYS ATOM 2076 CA LEU 77 32.920 -6.969 -5.221 109 ILE ATOM 2077 CA PRO 78 32.489 -4.046 -2.722 110 PRO ATOM 2078 CA ALA 79 35.437 -2.111 -4.237 111 ASN ATOM 2079 CA ILE 80 34.227 -2.756 -7.764 112 LEU ATOM 2080 CA LEU 81 30.781 -1.252 -7.052 113 LEU ATOM 2081 CA THR 82 32.104 1.738 -5.151 114 SER ATOM 2082 CA THR 83 34.136 2.720 -8.229 115 ALA ATOM 2083 CA THR 84 31.853 1.880 -11.128 116 VAL ATOM 2084 CA PHE 85 28.936 3.479 -9.272 117 CYS ATOM 2085 CA GLY 86 30.015 5.564 -6.295 118 GLY ATOM 2086 CA LYS 87 30.512 9.357 -6.128 119 GLU ATOM 2087 CA LEU 88 32.246 9.395 -9.489 120 GLY ATOM 2088 CA SER 89 29.236 8.287 -11.497 121 VAL ATOM 2089 CA LEU 90 26.247 9.945 -9.748 122 PHE ATOM 2090 CA ASP 91 25.391 15.019 -15.287 127 ILE ATOM 2091 CA GLY 92 22.122 14.607 -13.267 128 PRO ATOM 2092 CA GLU 93 20.704 11.527 -14.971 129 LEU ATOM 2093 CA VAL 94 22.904 8.515 -15.707 130 ILE ATOM 2094 CA LYS 95 22.461 4.760 -16.195 131 ARG ATOM 2095 CA LEU 96 25.002 1.945 -16.179 132 LEU ATOM 2096 CA ILE 97 23.892 -0.355 -18.995 133 GLN ATOM 2097 CA ASP 98 26.556 -3.091 -19.021 134 ASP ATOM 2098 CA LEU 99 29.927 -4.309 -17.636 135 ILE ATOM 2099 CA THR 100 32.391 -6.528 -19.519 136 ARG ATOM 2100 CA PHE 101 35.272 -8.237 -17.779 137 PHE ATOM 2101 CA SER 102 38.549 -9.587 -19.236 138 PRO ATOM 2102 CA ASP 103 39.569 -13.305 -18.657 139 GLU ATOM 2103 CA GLU 104 42.476 -12.377 -16.333 140 PRO ATOM 2104 CA LEU 105 40.011 -10.518 -14.091 141 TYR ATOM 2105 CA LYS 106 37.211 -13.115 -14.367 142 LEU ATOM 2106 CA LYS 107 39.668 -15.874 -13.500 143 ALA ATOM 2107 CA HIS 108 39.892 -14.428 -9.984 144 ALA ATOM 2108 CA PHE 109 36.270 -15.279 -9.067 145 PHE TER 99 198.660 3 4rubA1 ATOM 3001 CA GLY 1 71.584 37.454 18.952 27 ASP ATOM 3002 CA ILE 2 73.207 34.747 16.764 28 ILE ATOM 3003 CA ILE 3 73.676 36.485 13.366 29 LEU ATOM 3004 CA ALA 4 74.170 34.676 10.049 30 ALA ATOM 3005 CA THR 5 75.256 35.930 6.727 31 ALA ATOM 3006 CA TYR 6 73.613 33.651 4.073 32 PHE ATOM 3007 CA LEU 7 74.517 34.099 0.348 33 ARG ATOM 3008 CA ILE 8 71.099 33.543 -1.294 34 VAL ATOM 3009 CA HIS 9 70.276 32.940 -4.998 35 THR ATOM 3010 CA ASP 10 66.525 33.114 -5.541 36 PRO ATOM 3011 CA ASP 11 64.356 31.679 -8.083 37 GLN ATOM 3012 CA SER 12 60.348 35.719 -9.524 39 GLY ATOM 3013 CA HIS 13 61.448 35.825 -5.927 40 VAL ATOM 3014 CA ASN 14 62.231 39.213 -4.567 41 PRO ATOM 3015 CA LEU 15 65.347 38.928 -2.410 42 PRO ATOM 3016 CA GLU 16 63.491 40.310 0.571 43 GLU ATOM 3017 CA LYS 17 61.009 37.433 0.221 44 GLU ATOM 3018 CA LYS 18 63.804 34.795 -0.203 45 ALA ATOM 3019 CA ALA 19 65.599 36.313 2.780 46 GLY ATOM 3020 CA GLU 20 62.446 36.215 4.994 47 ALA ATOM 3021 CA GLN 21 61.660 32.606 3.955 48 ALA ATOM 3022 CA ILE 22 65.192 31.806 5.030 49 VAL ATOM 3023 CA ALA 23 64.593 33.553 8.393 50 ALA ATOM 3024 CA LEU 24 61.051 32.196 9.090 51 ALA ATOM 3025 CA GLY 25 61.523 28.573 8.203 52 GLU ATOM 3026 CA LEU 26 64.630 28.829 10.375 53 SER ATOM 3027 CA THR 27 63.099 29.994 13.647 54 SER ATOM 3028 CA ILE 28 59.404 30.244 14.244 55 THR ATOM 3029 CA GLY 29 57.260 30.002 11.188 56 GLY ATOM 3030 CA GLU 30 53.341 33.254 22.549 67 THR ATOM 3031 CA GLN 31 54.863 36.497 21.087 68 SER ATOM 3032 CA LEU 32 56.908 36.221 17.820 69 LEU ATOM 3033 CA LYS 33 58.519 39.556 18.405 70 ASP ATOM 3034 CA GLN 34 60.592 37.840 21.026 71 ARG ATOM 3035 CA HIS 35 61.285 34.653 19.139 72 TYR ATOM 3036 CA LYS 36 61.080 35.245 15.336 73 LYS ATOM 3037 CA GLY 37 64.281 34.894 13.334 74 GLY ATOM 3038 CA ASN 38 64.678 38.111 11.311 75 ARG ATOM 3039 CA VAL 39 66.171 39.177 8.049 76 CYS ATOM 3040 CA ILE 40 67.467 42.624 8.810 77 TYR ATOM 3041 CA HIS 41 69.277 43.216 5.546 78 ARG ATOM 3042 CA VAL 42 70.075 42.171 2.012 79 ILE ATOM 3043 CA GLU 43 73.075 43.208 -0.099 80 GLU ATOM 3044 CA GLU 44 73.818 42.572 -3.776 81 ARG ATOM 3045 CA LEU 45 76.741 40.347 -4.527 82 VAL ATOM 3046 CA ALA 46 78.654 42.773 -6.607 83 VAL ATOM 3047 CA GLU 47 79.132 41.275 -10.014 84 GLY ATOM 3048 CA LYS 58 77.002 38.256 -9.474 85 GLU ATOM 3049 CA VAL 59 74.149 36.484 -10.955 86 LYS ATOM 3050 CA LYS 60 71.124 37.437 -8.901 87 ASP ATOM 3051 CA ARG 61 72.995 36.481 -5.730 88 GLN ATOM 3052 CA GLY 62 72.712 38.248 -2.412 89 TYR ATOM 3053 CA ILE 63 73.792 38.249 1.189 90 ILE ATOM 3054 CA ILE 64 70.692 37.973 3.361 91 ALA ATOM 3055 CA LYS 65 71.660 38.745 6.977 92 TYR ATOM 3056 CA ILE 66 69.535 37.063 9.640 93 VAL ATOM 3057 CA GLU 67 69.396 37.486 13.380 94 ALA ATOM 3058 CA TYR 68 68.390 34.765 15.816 95 TYR ATOM 3059 CA PRO 69 67.515 35.569 19.431 96 PRO ATOM 3060 CA LEU 70 69.467 33.573 22.076 97 LEU ATOM 3061 CA LEU 71 66.302 32.035 23.616 98 ASP ATOM 3062 CA ASN 72 66.074 29.792 20.549 99 LEU ATOM 3063 CA PHE 73 69.167 27.600 21.045 100 PHE ATOM 3064 CA SER 74 69.745 24.850 23.558 101 GLU ATOM 3065 CA PRO 75 72.860 25.557 25.552 102 GLU ATOM 3066 CA ASP 76 74.564 22.064 21.611 104 SER ATOM 3067 CA LEU 77 76.074 22.734 18.163 105 VAL ATOM 3068 CA PRO 78 73.537 20.014 17.136 106 THR ATOM 3069 CA ALA 79 70.631 22.255 18.022 107 ASN ATOM 3070 CA ILE 80 72.250 25.427 16.519 108 MET ATOM 3071 CA LEU 81 72.839 23.704 13.173 109 PHE ATOM 3072 CA THR 82 69.363 22.039 13.300 110 THR ATOM 3073 CA THR 83 67.954 25.585 13.379 111 SER ATOM 3074 CA THR 84 70.138 27.631 11.038 112 ILE ATOM 3075 CA PHE 85 70.539 24.934 8.395 113 VAL ATOM 3076 CA GLY 86 67.714 22.477 9.094 114 GLY ATOM 3077 CA LYS 87 65.323 23.030 6.240 115 ASN ATOM 3078 CA LEU 88 65.906 26.293 4.335 116 VAL ATOM 3079 CA SER 89 68.491 24.944 1.955 117 PHE ATOM 3080 CA LEU 90 61.593 29.314 -3.888 121 ALA ATOM 3081 CA ASP 91 65.466 29.263 -3.739 122 LEU ATOM 3082 CA GLY 92 67.793 27.694 -6.220 123 ARG ATOM 3083 CA GLU 93 70.989 27.761 -4.208 124 ALA ATOM 3084 CA VAL 94 71.651 28.750 -0.503 125 LEU ATOM 3085 CA LYS 95 75.052 28.903 1.327 126 ARG ATOM 3086 CA LEU 96 75.942 29.908 4.953 127 LEU ATOM 3087 CA ILE 97 79.073 32.017 4.886 128 GLU ATOM 3088 CA ASP 98 79.479 33.033 8.508 129 ASP ATOM 3089 CA LEU 99 77.743 33.008 11.929 130 LEU ATOM 3090 CA THR 100 78.405 35.437 14.756 131 ARG ATOM 3091 CA PHE 101 78.391 33.534 18.022 132 ILE ATOM 3092 CA SER 102 77.597 35.836 20.972 133 PRO ATOM 3093 CA ASP 103 79.576 35.542 24.188 134 PRO ATOM 3094 CA GLU 104 76.405 34.598 26.011 135 ALA ATOM 3095 CA LEU 105 76.244 31.474 23.857 136 TYR ATOM 3096 CA LYS 106 79.984 30.980 23.685 137 VAL ATOM 3097 CA LYS 107 80.019 30.612 27.514 138 LYS ATOM 3098 CA HIS 108 77.727 27.726 27.316 139 THR ATOM 3099 CA PHE 109 80.378 25.517 25.575 140 PHE TER 99 197.620 4 1iwaA1 ATOM 4001 CA GLY 1 26.055 2.232 87.517 31 ASP ATOM 4002 CA ILE 2 24.159 -0.466 85.649 32 VAL ATOM 4003 CA ILE 3 21.343 -1.710 87.862 33 LEU ATOM 4004 CA ALA 4 19.565 -5.047 87.878 34 ALA ATOM 4005 CA THR 5 16.559 -6.479 89.697 35 LEU ATOM 4006 CA TYR 6 16.465 -10.215 90.211 36 PHE ATOM 4007 CA LEU 7 13.616 -12.353 91.501 37 ARG ATOM 4008 CA ILE 8 15.612 -14.732 93.689 38 VAL ATOM 4009 CA HIS 9 14.368 -18.059 95.029 39 THR ATOM 4010 CA ASP 10 17.193 -19.310 97.286 40 PRO ATOM 4011 CA ASP 11 17.508 -23.017 98.027 41 GLN ATOM 4012 CA SER 12 18.390 -23.156 104.132 43 GLY ATOM 4013 CA HIS 13 20.149 -20.570 101.984 44 VAL ATOM 4014 CA ASN 14 20.152 -17.060 103.446 45 ASP ATOM 4015 CA LEU 15 18.343 -14.724 101.012 46 PRO ATOM 4016 CA GLU 16 20.995 -12.079 101.641 47 ILE ATOM 4017 CA LYS 17 23.802 -14.539 100.880 48 GLU ATOM 4018 CA LYS 18 21.979 -15.792 97.783 49 ALA ATOM 4019 CA ALA 19 21.654 -12.215 96.536 50 ALA ATOM 4020 CA GLU 20 25.294 -11.495 97.276 51 ALA ATOM 4021 CA GLN 21 26.096 -14.790 95.561 52 ALA ATOM 4022 CA ILE 22 24.336 -13.606 92.422 53 VAL ATOM 4023 CA ALA 23 26.106 -10.253 92.645 54 ALA ATOM 4024 CA LEU 24 29.579 -11.744 93.011 55 GLY ATOM 4025 CA GLY 25 29.328 -14.467 90.379 56 GLU ATOM 4026 CA LEU 26 28.034 -11.919 87.880 57 SER ATOM 4027 CA THR 27 30.934 -9.531 88.475 58 SER ATOM 4028 CA ILE 28 34.375 -10.473 89.864 59 THR ATOM 4029 CA GLY 29 33.900 -13.185 92.519 60 ALA ATOM 4030 CA GLU 30 42.843 -4.365 91.080 71 THR ATOM 4031 CA GLN 31 40.565 -1.640 92.388 72 ALA ATOM 4032 CA LEU 32 38.393 -4.542 93.585 73 ALA ATOM 4033 CA LYS 33 36.342 -2.345 95.924 74 ASP ATOM 4034 CA GLN 34 35.082 -0.566 92.819 75 LEU ATOM 4035 CA HIS 35 34.789 -3.593 90.506 76 TYR ATOM 4036 CA LYS 36 32.859 -5.836 92.911 77 ARG ATOM 4037 CA GLY 37 29.102 -5.595 92.376 78 ALA ATOM 4038 CA ASN 38 26.860 -4.868 95.360 79 LYS ATOM 4039 CA VAL 39 23.521 -6.411 96.239 80 ALA ATOM 4040 CA ILE 40 22.295 -3.224 97.888 81 TYR ATOM 4041 CA HIS 41 18.690 -4.229 98.540 82 LYS ATOM 4042 CA VAL 42 16.650 -7.375 99.136 83 VAL ATOM 4043 CA GLU 43 12.950 -7.679 99.969 84 ASP ATOM 4044 CA GLU 44 10.594 -10.633 99.927 85 GLN ATOM 4045 CA LEU 45 8.079 -10.925 97.084 86 VAL ATOM 4046 CA ALA 46 4.540 -9.646 97.925 87 PRO ATOM 4047 CA GLU 47 2.843 -13.058 98.024 88 ASN ATOM 4048 CA LYS 58 5.710 -15.524 97.900 89 ASN ATOM 4049 CA VAL 59 7.910 -16.156 100.966 90 PRO ATOM 4050 CA LYS 60 10.143 -18.241 98.692 91 GLU ATOM 4051 CA ARG 61 11.102 -15.396 96.347 92 GLN ATOM 4052 CA GLY 62 12.919 -12.130 96.958 93 TYR ATOM 4053 CA ILE 63 13.484 -9.153 94.685 94 PHE ATOM 4054 CA ILE 64 17.143 -8.179 94.829 95 ALA ATOM 4055 CA LYS 65 18.630 -4.933 93.556 96 TYR ATOM 4056 CA ILE 66 22.234 -5.185 92.353 97 ILE ATOM 4057 CA GLU 67 24.578 -2.449 91.128 98 ALA ATOM 4058 CA TYR 68 27.477 -2.824 88.686 99 TYR ATOM 4059 CA PRO 69 30.282 -0.388 87.860 100 GLU ATOM 4060 CA LEU 70 30.231 1.087 84.340 101 LEU ATOM 4061 CA LEU 71 33.873 0.173 83.687 102 ASP ATOM 4062 CA ASN 72 32.944 -3.505 83.915 103 LEU ATOM 4063 CA PHE 73 31.249 -3.369 80.529 104 PHE ATOM 4064 CA SER 74 32.499 -3.095 76.968 105 GLU ATOM 4065 CA PRO 75 28.071 -0.886 72.851 107 GLY ATOM 4066 CA ASP 76 28.177 -4.661 73.333 108 SER ATOM 4067 CA LEU 77 25.038 -6.636 74.147 109 ILE ATOM 4068 CA PRO 78 27.083 -9.827 74.240 110 ALA ATOM 4069 CA ALA 79 29.427 -8.474 76.907 111 ASN ATOM 4070 CA ILE 80 26.604 -7.052 79.030 112 LEU ATOM 4071 CA LEU 81 24.721 -10.369 79.046 113 THR ATOM 4072 CA THR 82 27.884 -12.442 79.424 114 ALA ATOM 4073 CA THR 83 28.082 -10.859 82.855 115 SER ATOM 4074 CA THR 84 24.473 -10.343 83.969 116 ILE ATOM 4075 CA PHE 85 23.242 -13.755 82.808 117 ILE ATOM 4076 CA GLY 86 26.579 -15.559 82.533 118 GLY ATOM 4077 CA LYS 87 26.436 -18.194 85.294 119 ASN ATOM 4078 CA LEU 88 24.128 -16.960 88.059 120 VAL ATOM 4079 CA SER 89 21.188 -18.877 86.602 121 PHE ATOM 4080 CA LEU 90 22.400 -22.560 95.974 125 ALA ATOM 4081 CA ASP 91 19.800 -20.625 93.972 126 VAL ATOM 4082 CA GLY 92 16.783 -22.869 93.314 127 LYS ATOM 4083 CA GLU 93 15.358 -20.404 90.740 128 ALA ATOM 4084 CA VAL 94 16.257 -17.014 89.238 129 LEU ATOM 4085 CA LYS 95 14.794 -14.330 86.988 130 ARG ATOM 4086 CA LEU 96 16.119 -11.052 85.640 131 LEU ATOM 4087 CA ILE 97 13.037 -8.841 85.931 132 GLU ATOM 4088 CA ASP 98 14.363 -5.424 84.899 133 ASP ATOM 4089 CA LEU 99 17.493 -3.337 84.420 134 MET ATOM 4090 CA THR 100 18.547 0.286 84.740 135 ARG ATOM 4091 CA PHE 101 20.975 1.165 81.987 136 LEU ATOM 4092 CA SER 102 22.913 4.369 82.774 137 PRO ATOM 4093 CA ASP 103 22.797 7.240 80.299 138 LEU ATOM 4094 CA GLU 104 26.573 7.145 79.759 139 ALA ATOM 4095 CA LEU 105 26.302 3.468 78.854 140 TYR ATOM 4096 CA LYS 106 23.312 4.036 76.569 141 LEU ATOM 4097 CA LYS 107 25.187 6.691 74.563 142 LYS ATOM 4098 CA HIS 108 27.630 3.983 73.443 143 THR ATOM 4099 CA PHE 109 24.827 2.151 71.618 144 PHE TER 87 169.100 5 3qfwA1 ATOM 5001 CA GLY 1 7.184 31.359 4.773 4 ARG ATOM 5002 CA ILE 2 6.446 34.975 5.510 5 ILE ATOM 5003 CA ILE 3 2.770 35.285 6.340 6 VAL ATOM 5004 CA ALA 4 1.442 38.693 5.330 7 ALA ATOM 5005 CA THR 5 -2.085 39.756 6.218 8 THR ATOM 5006 CA TYR 6 -3.910 42.092 3.821 9 TYR ATOM 5007 CA LEU 7 -7.256 43.804 4.141 10 HIS ATOM 5008 CA ILE 8 -9.280 43.811 0.967 11 ILE ATOM 5009 CA HIS 9 -12.361 45.696 -0.168 12 ALA ATOM 5010 CA ASP 10 -14.255 43.082 -2.175 13 SER ATOM 5011 CA ASP 11 -17.531 41.229 -2.692 14 ASP ATOM 5012 CA SER 12 -18.140 37.644 -1.598 15 ALA ATOM 5013 CA HIS 13 -18.315 36.664 -5.276 16 GLU ATOM 5014 CA ASN 14 -14.923 38.077 -6.277 17 ARG ATOM 5015 CA LEU 15 -12.972 37.801 -3.002 18 ILE ATOM 5016 CA GLU 16 -11.622 34.267 -3.542 19 GLU ATOM 5017 CA LYS 17 -10.389 35.249 -7.009 20 GLN ATOM 5018 CA LYS 18 -9.059 38.593 -5.799 21 ARG ATOM 5019 CA ALA 19 -7.128 36.770 -3.081 22 ALA ATOM 5020 CA GLU 20 -5.506 34.426 -5.584 23 LEU ATOM 5021 CA GLN 21 -4.563 37.366 -7.799 24 ALA ATOM 5022 CA ILE 22 -3.038 39.019 -4.727 25 LEU ATOM 5023 CA ALA 23 -0.919 35.927 -4.003 26 ALA ATOM 5024 CA LEU 24 0.362 36.084 -7.601 27 ILE ATOM 5025 CA GLY 25 0.928 39.861 -7.641 28 GLU ATOM 5026 CA LEU 26 3.238 39.674 -4.611 29 GLN ATOM 5027 CA THR 27 4.973 36.633 -6.016 30 SER ATOM 5028 CA ILE 28 5.741 35.673 -9.579 31 VAL ATOM 5029 CA GLY 29 3.458 38.269 -11.113 32 GLU ATOM 5030 CA GLU 30 0.685 29.354 -17.989 36 GLU ATOM 5031 CA GLN 31 3.899 31.396 -18.055 37 ALA ATOM 5032 CA LEU 32 5.581 29.031 -15.599 38 ILE ATOM 5033 CA GLN 34 7.719 26.850 -4.113 39 ASN ATOM 5034 CA HIS 35 7.611 30.510 -5.142 40 ILE ATOM 5035 CA LYS 36 4.023 31.330 -6.086 41 VAL ATOM 5036 CA GLY 37 2.333 32.918 -3.065 42 GLY ATOM 5037 CA ASN 38 -0.096 30.751 -1.126 43 ARG ATOM 5038 CA VAL 39 -3.488 31.999 -0.008 44 VAL ATOM 5039 CA ILE 40 -3.385 30.566 3.512 45 GLU ATOM 5040 CA HIS 41 -6.712 31.970 4.661 46 ASP ATOM 5041 CA VAL 42 -9.655 34.184 3.760 47 VAL ATOM 5042 CA GLU 43 -11.970 35.652 6.381 48 ALA ATOM 5043 CA GLU 44 -14.858 38.104 6.386 49 GLU ATOM 5044 CA LEU 45 -14.218 41.027 8.721 50 LEU ATOM 5045 CA LYS 58 -17.333 42.947 7.760 51 GLN ATOM 5046 CA VAL 59 -19.503 42.717 4.659 52 PRO ATOM 5047 CA LYS 60 -17.235 44.010 1.890 53 GLY ATOM 5048 CA ARG 61 -14.046 43.662 3.924 54 ARG ATOM 5049 CA GLY 62 -11.879 40.555 4.067 55 TYR ATOM 5050 CA ILE 63 -8.651 39.700 5.826 56 ALA ATOM 5051 CA ILE 64 -6.425 37.621 3.563 57 VAL ATOM 5052 CA LYS 65 -3.399 35.721 4.848 58 ARG ATOM 5053 CA ILE 66 -0.789 35.026 2.190 59 ILE ATOM 5054 CA GLU 67 2.198 32.744 2.571 60 GLY ATOM 5055 CA TYR 68 5.147 34.277 0.744 61 LEU ATOM 5056 CA PRO 69 8.305 32.278 0.057 62 ALA ATOM 5057 CA LEU 70 11.138 33.669 2.189 63 ALA ATOM 5058 CA LEU 71 13.534 33.080 -0.687 64 ALA ATOM 5059 CA ASN 72 11.899 35.934 -2.634 65 THR ATOM 5060 CA PHE 73 12.515 38.404 0.176 66 ALA ATOM 5061 CA SER 74 16.030 38.442 1.680 67 PRO ATOM 5062 CA PRO 75 16.537 40.274 4.994 68 ALA ATOM 5063 CA ASP 76 17.005 43.552 3.111 69 GLU ATOM 5064 CA LEU 77 14.485 46.238 4.164 70 PRO ATOM 5065 CA PRO 78 13.652 47.721 0.741 71 GLY ATOM 5066 CA ALA 79 13.323 44.311 -0.918 72 GLN ATOM 5067 CA ILE 80 11.189 43.003 1.941 73 LEU ATOM 5068 CA LEU 81 8.851 45.961 1.521 74 LEU ATOM 5069 CA THR 82 8.996 45.298 -2.241 75 ASN ATOM 5070 CA THR 83 7.789 41.709 -1.877 76 MET ATOM 5071 CA THR 84 5.230 42.611 0.803 77 LEU ATOM 5072 CA PHE 85 3.479 45.439 -1.003 78 PHE ATOM 5073 CA GLY 86 5.515 46.792 -3.906 79 GLY ATOM 5074 CA LYS 87 2.972 46.264 -6.679 80 ASN ATOM 5075 CA LEU 88 -0.171 45.955 -4.599 81 SER ATOM 5076 CA SER 89 0.383 49.405 -3.168 82 SER ATOM 5077 CA LEU 90 -0.779 50.637 -6.590 83 ILE ATOM 5078 CA ASP 91 -4.188 49.013 -6.173 84 GLN ATOM 5079 CA GLY 92 -6.973 50.964 -4.398 85 PRO ATOM 5080 CA GLU 93 -8.761 48.001 -2.785 86 ASP ATOM 5081 CA VAL 94 -5.960 46.628 -0.598 87 ILE ATOM 5082 CA LYS 95 -3.998 47.489 2.517 88 ALA ATOM 5083 CA LEU 96 -1.113 45.643 4.137 89 LEU ATOM 5084 CA ILE 97 -2.229 45.001 7.743 90 ALA ATOM 5085 CA ASP 98 0.343 42.750 9.432 91 ASP ATOM 5086 CA LEU 99 3.359 40.557 8.778 92 VAL ATOM 5087 CA THR 100 4.569 37.445 10.616 93 GLU TER